Vitas-M small molecule compound

{7-[bis(methylsulfanyl)methylidene]-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(phenyl)methanone

Catalog ID
STK993216
SMILES CSC(=C1CCCC2C1=NN(C2c1ccccc1)C(=O)c1ccccc1)SC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C23H24N2OS2 MW 408.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2OS2/c1-27-23(28-2)19-15-9-14-18-20(19)24-25(21(18)16-10-5-3-6-11-16)22(26)17-12-7-4-8-13-17/h3-8,10-13,18,21H,9,14-15H2,1-2H3
InChIKey
IISJHRJUPUHURQ-UHFFFAOYSA-N
Synonyms

(7(bis(methylsulfanyl)methylidene)3phenyl33a4567hexahydro2Hindazol2yl)(phenyl)methanone
(7(bis(methylsulfanyl)methylidene)3phenyl3a456tetrahydro3Hindazol2yl)phenylmethanone
CSC(=C1CCCC2C1=NN(C2C3=CC=CC=C3)C(=O)C4=CC=CC=C4)SC
InChI=1SC23H24N2OS2c12723(282)19159141820(19)2425(21(18)16105361116)22(26)17127481317h3810131821H91415H212H3
MFCD18184790
ZINC000051329758
ZINC000051329763

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.